Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | DHFR | P00374 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | TYMP | P19971 | 2/20 | 0.36 |
| ▸ | MAP2 | P11137 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7711087 | 0.87 | ALDH1A1 (0.50) | HTTCYP1A2LMNAMAPTALDH1A1 | |
| SCHEMBL9844862 | 0.86 | HTT (0.37) | HTTCYP1A2LMNAMAPTALDH1A1 | |
| SCHEMBL6472472 | 0.85 | HTT (0.40) | HTTCYP1A2LMNAMAPTALDH1A1 | |
| SCHEMBL14182621 | 0.84 | LMNA (0.48) | HTTLMNAMAPTALDH1A1DHFR | |
| SCHEMBL247368 | 0.84 | LMNA (0.48) | HTTLMNAMAPTALDH1A1DHFR | |
| SCHEMBL26218697 | 0.82 | HTT (0.42) | HTTCYP1A2LMNAMAPTALDH1A1 | |
| SCHEMBL7704707 | 0.81 | LMNA (0.46) | HTTLMNAMAPTALDH1A1DHFR | |
| SCHEMBL1179753 | 0.81 | ALDH1A1 (0.50) | HTTCYP1A2LMNAMAPTALDH1A1 | |
| SCHEMBL29088482 | 0.80 | HTT (0.40) | HTTCYP1A2LMNAMAPTALDH1A1 | |
| SCHEMBL31305580 | 0.79 | LMNA (0.43) | HTTLMNAMAPTALDH1A1DHFR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116948656-B | Application of ionic liquid in preparation of fluoroalkyl cyclohexyl biphenyl liquid crystal compounds | 河北美星化工有限公司 | 2024-07-09 | — | — | CN | disclosed |
| CN-116948656-A | Application of ionic liquid in preparation of fluoroalkyl cyclohexyl biphenyl liquid crystal compounds | 河北美星化工有限公司 | 2023-10-27 | — | — | CN | disclosed |